In quantum calculations a transformed Hamiltonian is often used to avoid singularities in a certain basis set or to reduce computation time. We demonstrate for the Fourier basis set that the Hamiltonian can not be arb...In quantum calculations a transformed Hamiltonian is often used to avoid singularities in a certain basis set or to reduce computation time. We demonstrate for the Fourier basis set that the Hamiltonian can not be arbitrarily transformed. Otherwise, the Hamiltonian matrix becomes non-hermitian, which may lead to numerical problems. Methods for cor- rectly constructing the Hamiltonian operators are discussed. Specific examples involving the Fourier basis functions for a triatomic molecular Hamiltonian （J=0） in bond-bond angle and Radau coordinates are presented. For illustration, absorption spectra are calculated for the OC10 molecule using the time-dependent wavepacket method. Numerical results indicate that the non-hermiticity of the Hamiltonian matrix may also result from integration errors. The conclusion drawn here is generally useful for quantum calculation using basis expansion method using quadrature scheme.展开更多
高耸结构P-Δ效应的传统分析方法一般难以考虑时变轴力作用,有可能会低估P-Δ效应对结构安全性的影响.本文应用求积单元法(weak form quadrature element method,QEM),针对分布质量结构体系和含有集中质量的结构体系分别建立Hermite型...高耸结构P-Δ效应的传统分析方法一般难以考虑时变轴力作用,有可能会低估P-Δ效应对结构安全性的影响.本文应用求积单元法(weak form quadrature element method,QEM),针对分布质量结构体系和含有集中质量的结构体系分别建立Hermite型求积单元模型,发展了一种高耸结构P-Δ效应高阶精确分析方法.该方法能够应用于具有突变质量的结构体系,可处理任意轴向荷载引起的动力P-Δ效应问题,无需迭代计算即可获得高精度的P-Δ效应解答,同时能准确地揭示竖向荷载以及时变轴力对高耸结构特性的影响规律.通过对3个不同类型案例的比较分析,验证了本文方法的可行性和准确性.数值分析结果表明,本文方法可以实现高精度的P-Δ效应分析,对于质量均匀分布和含有集中质量的结构体系仅需使用一个求积单元即可获得非常精确的动态响应结果.展开更多
A distinguished category of operational fluids,known as hybrid nanofluids,occupies a prominent role among various fluid types owing to its superior heat transfer properties.By employing a dovetail fin profile,this wor...A distinguished category of operational fluids,known as hybrid nanofluids,occupies a prominent role among various fluid types owing to its superior heat transfer properties.By employing a dovetail fin profile,this work investigates the thermal reaction of a dynamic fin system to a hybrid nanofluid with shape-based properties,flowing uniformly at a velocity U.The analysis focuses on four distinct types of nanoparticles,i.e.,Al2O3,Ag,carbon nanotube(CNT),and graphene.Specifically,two of these particles exhibit a spherical shape,one possesses a cylindrical form,and the final type adopts a platelet morphology.The investigation delves into the pairing of these nanoparticles.The examination employs a combined approach to assess the constructional and thermal exchange characteristics of the hybrid nanofluid.The fin design,under the specified circumstances,gives rise to the derivation of a differential equation.The given equation is then transformed into a dimensionless form.Notably,the Hermite wavelet method is introduced for the first time to address the challenge posed by a moving fin submerged in a hybrid nanofluid with shape-dependent features.To validate the credibility of this research,the results obtained in this study are systematically compared with the numerical simulations.The examination discloses that the highest heat flux is achieved when combining nanoparticles with spherical and platelet shapes.展开更多
基金This work was supported by the National Basic Research Program of China （No.2013CB922200）, the National Natural Science Foundation of China （No.21222308, No.21103187, and No.21133006）, the Chinese Academy of Sciences, and the Key Research Program of the Chinese Academy of Sciences.
文摘In quantum calculations a transformed Hamiltonian is often used to avoid singularities in a certain basis set or to reduce computation time. We demonstrate for the Fourier basis set that the Hamiltonian can not be arbitrarily transformed. Otherwise, the Hamiltonian matrix becomes non-hermitian, which may lead to numerical problems. Methods for cor- rectly constructing the Hamiltonian operators are discussed. Specific examples involving the Fourier basis functions for a triatomic molecular Hamiltonian （J=0） in bond-bond angle and Radau coordinates are presented. For illustration, absorption spectra are calculated for the OC10 molecule using the time-dependent wavepacket method. Numerical results indicate that the non-hermiticity of the Hamiltonian matrix may also result from integration errors. The conclusion drawn here is generally useful for quantum calculation using basis expansion method using quadrature scheme.
文摘高耸结构P-Δ效应的传统分析方法一般难以考虑时变轴力作用,有可能会低估P-Δ效应对结构安全性的影响.本文应用求积单元法(weak form quadrature element method,QEM),针对分布质量结构体系和含有集中质量的结构体系分别建立Hermite型求积单元模型,发展了一种高耸结构P-Δ效应高阶精确分析方法.该方法能够应用于具有突变质量的结构体系,可处理任意轴向荷载引起的动力P-Δ效应问题,无需迭代计算即可获得高精度的P-Δ效应解答,同时能准确地揭示竖向荷载以及时变轴力对高耸结构特性的影响规律.通过对3个不同类型案例的比较分析,验证了本文方法的可行性和准确性.数值分析结果表明,本文方法可以实现高精度的P-Δ效应分析,对于质量均匀分布和含有集中质量的结构体系仅需使用一个求积单元即可获得非常精确的动态响应结果.
文摘A distinguished category of operational fluids,known as hybrid nanofluids,occupies a prominent role among various fluid types owing to its superior heat transfer properties.By employing a dovetail fin profile,this work investigates the thermal reaction of a dynamic fin system to a hybrid nanofluid with shape-based properties,flowing uniformly at a velocity U.The analysis focuses on four distinct types of nanoparticles,i.e.,Al2O3,Ag,carbon nanotube(CNT),and graphene.Specifically,two of these particles exhibit a spherical shape,one possesses a cylindrical form,and the final type adopts a platelet morphology.The investigation delves into the pairing of these nanoparticles.The examination employs a combined approach to assess the constructional and thermal exchange characteristics of the hybrid nanofluid.The fin design,under the specified circumstances,gives rise to the derivation of a differential equation.The given equation is then transformed into a dimensionless form.Notably,the Hermite wavelet method is introduced for the first time to address the challenge posed by a moving fin submerged in a hybrid nanofluid with shape-dependent features.To validate the credibility of this research,the results obtained in this study are systematically compared with the numerical simulations.The examination discloses that the highest heat flux is achieved when combining nanoparticles with spherical and platelet shapes.
